3-(piperidin-1-ylmethyl)-5-(2,4,4-trimethylpentan-2-yl)benzene-1,2-diol
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3-(piperidin-1-ylmethyl)-5-(2,4,4-trimethylpentan-2-yl)benzene-1,2-diol
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CAS No:
5414-51-7
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Formula:
C20H33NO2
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Chemical Name:
3-(piperidin-1-ylmethyl)-5-(2,4,4-trimethylpentan-2-yl)benzene-1,2-diol
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Synonyms:
NSC10580;5414-51-7;NSC-10580;3-(1-piperidinylmethyl)-5-(1,1,3,3-tetramethylbutyl)-1,2-benzenediol;NCIStruc1_001202;NCIStruc2_000789;CHEMBL1325511;SCHEMBL13038431;DTXSID20278906;NCI10580;ZINC1706300;CCG-36729;NCGC00013115;NCGC00013115-02;NCGC00096236-01;NCI60_000139
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CAS No:
3-(piperidin-1-ylmethyl)-5-(2,4,4-trimethylpentan-2-yl)benzene-1,2-diol Basic Attributes
319.5 g/mol
319.251129295 g/mol
10580
DTXSID20278906
Computed Properties
Molecular Weight:319.5
XLogP3:5.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:319.251129295
Monoisotopic Mass:319.251129295
Topological Polar Surface Area:43.7
Heavy Atom Count:23
Complexity:368
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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